SCHEMBL4078264

SCHEMBL4078264

CCN(CC)CCC(CN)N(CC)CC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.32
PLA2G2A P14555 1/20 0.32
SIGMAR1 Q99720 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7940908 0.81 SIGMAR1 (0.32) PLA2G1BPLA2G2ASIGMAR1
SCHEMBL29444105 0.79 PLA2G1B (0.33) PLA2G1BPLA2G2ASIGMAR1
SCHEMBL27844285 0.78
SCHEMBL9076826 0.74 FDPS (0.30)
SCHEMBL4855953 0.73 OPRM1 (0.41) PLA2G1BPLA2G2A
SCHEMBL31549962 0.72 SIGMAR1 (0.35) PLA2G1BPLA2G2ASIGMAR1
SCHEMBL20225636 0.72
SCHEMBL3678877 0.72
SCHEMBL10796465 0.71 PLA2G1B (0.34) PLA2G1BPLA2G2ASIGMAR1
SCHEMBL3538833 0.71 PLA2G1B (0.43) PLA2G1BPLA2G2ASIGMAR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2082005-A1 LIGAND EXCHANGE THERMOCHROMIC, (LETC), SYSTEMS Pleotint, L.L.C. (US) 2009-07-29 EP disclosed
WO-2008028128-A1 LIGAND EXCHANGE THERMOCHROMIC, (LETC), SYSTEMS PLEOTINT, L.L.C. (US) 2008-03-06 WO disclosed